N-[(3-ethoxy-2-phenylmethoxy-phenyl)methyl]-3,5-dimethyl-adamantan-1-amine

Systemtic Name: N-[(3-ethoxy-2-phenylmethoxy-phenyl)methyl]-3,5-dimethyl-adamantan-1-amine Openeye Name: N-[(2-benzyloxy-3-ethoxy-phenyl)methyl]-3,5-dimethyl-adamantan-1-amine CAS Name: N-[(3-ethoxy-2-phenylmethoxyphenyl)methyl]-3,5-dimethyl-1-adamantanamine IUPAC Name: N-[(3-ethoxy-2-phenylmethoxyphenyl)methyl]-3,5-dimethyladamantan-1-amine Traditional Name: (2-benzoxy-3-ethoxy-benzyl)-(3,5-dimethyl-1-adamantyl)amine Formula: C28H37NO2 MolecularWeight: 419.59888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1OCC2=CC=CC=C2)CNC34CC5CC(C3)(CC(C5)(C4)C)C

Isomeric SMILES

CCOC1=CC=CC(=C1OCC2=CC=CC=C2)CNC34CC5CC(C3)(CC(C5)(C4)C)C

InChI

InChI=1S/C28H37NO2/c1-4-30-24-12-8-11-23(25(24)31-17-21-9-6-5-7-10-21)16-29-28-15-22-13-26(2,19-28)18-27(3,14-22)20-28/h5-12,22,29H,4,13-20H2,1-3H3